2-methylsulfanylethyl (6S)-3,4-dimethyl-2-oxidanylidene-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methylsulfanylethyl (6S)-3,4-dimethyl-2-oxidanylidene-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methylsulfanylethyl (6S)-3,4-dimethyl-2-oxo-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3,4-dimethyl-2-oxo-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid 2-(methylthio)ethyl ester IUPAC Name: 2-methylsulfanylethyl (6S)-3,4-dimethyl-2-oxo-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-2-keto-3,4-dimethyl-6-[4-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid 2-(methylthio)ethyl ester Formula: C17H19F3N2O3S MolecularWeight: 388.40457

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C)C2=CC=C(C=C2)C(F)(F)F)C(=O)OCCSC

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1C)C2=CC=C(C=C2)C(F)(F)F)C(=O)OCCSC

InChI

InChI=1S/C17H19F3N2O3S/c1-10-13(15(23)25-8-9-26-3)14(21-16(24)22(10)2)11-4-6-12(7-5-11)17(18,19)20/h4-7,14H,8-9H2,1-3H3,(H,21,24)/t14-/m0/s1